Geometry & MOs

Info

ID:	46197
PubChem CID:	10522983
Reduced:	N3O4C20H21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	-133.69
Dipole, Da:	4.51
IP(EA), eV:	-8.57(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2Z)-2-(3,3-dicyano-2-phenylprop-2-enylidene)-1,3-thiazinane-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1C(=O)NC2=C(N1C(=O)NC3=CC=CC=C3)C=C(C(=C2)C)C

DOS

IR

Vibrations